SCHEMBL18157326

SCHEMBL18157326

Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/C=C/c3ccc(Br)cc3)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
APP P05067 3/20 0.36
TP53 P04637 1/20 0.34
ALDH1A1 P00352 4/20 0.33
NFE2L2 Q16236 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
KMT2A Q03164 3/20 0.32
MAPT P10636 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
POLB P06746 2/20 0.32
MAPK1 P28482 2/20 0.32
RECQL P46063 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
RAD52 P43351 2/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NSD2 O96028 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20109433 0.90 APP (0.45) NPC1RAB9AAPPALDH1A1NFE2L2
SCHEMBL13237078 0.87 APP (0.40) RAB9AAPPALDH1A1TRPM8KMT2A
SCHEMBL18157328 0.86 PTGS2 (0.41) NPC1RAB9AAPPTP53ALDH1A1
SCHEMBL13237082 0.86 APP (0.42) RAB9AAPPALDH1A1TRPM8KMT2A
SCHEMBL18157317 0.83 APP (0.40) NPC1RAB9AAPPALDH1A1NFE2L2
SCHEMBL2153287 0.82 RELA (0.44) NPC1RAB9AAPPTP53ALDH1A1
SCHEMBL14537271 0.82 RELA (0.44) NPC1RAB9AAPPTP53ALDH1A1
SCHEMBL14537277 0.82 RELA (0.44) NPC1RAB9AAPPTP53ALDH1A1
SCHEMBL11976748 0.81 ALDH1A1 (0.38) NPC1RAB9AAPPALDH1A1TRPM8
SCHEMBL14099255 0.80 APP (0.43) NPC1RAB9AAPPTP53ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663447-B2 Asymmetric butadiene-based charge transport compound, electrophotographic photoreceptor containing same, and image forming apparatus S-PRINTING SOLUTION CO., LTD. (KR) 2017-05-30 US disclosed
US-9663447-B2 Asymmetric butadiene-based charge transport compound, electrophotographic photoreceptor containing same, and image forming apparatus S-PRINTING SOLUTION CO., LTD. (KR) 2017-05-30 US disclosed
US-20160304437-A1 ASYMMETRIC BUTADIENE-BASED CHARGE TRANSPORT COMPOUND, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CONTAINING SAME, AND IMAGE FORMING APPARATUS SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 US disclosed
US-20160304437-A1 ASYMMETRIC BUTADIENE-BASED CHARGE TRANSPORT COMPOUND, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CONTAINING SAME, AND IMAGE FORMING APPARATUS SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-10-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160304437-A1 ASYMMETRIC BUTADIENE-BASED CHARGE TRANSPORT COMPOUND, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CONTAINING SAME, AND IMAGE FORMING APPARATUS ALDH1A2, USE1, SLC9A1 NPC1 662/4885RAB9A 2123/4885APP 2156/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.